Acetonitrile → HCID 11503141, compound

HRID 687448Notes

Reaction equation

HRID 687448 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[N:5]1[S:6](=[O:18])(=[O:19])[C:7]([c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)=[C:8]([Cl:11])[C:9]1=[O:10].[CH3:33][C:34]#[N:35].[O:20]1[CH2:21][CH2:22][N:23]([c:26]2[cH:27][cH:28][c:29]([NH2:32])[cH:30][n:31]2)[CH2:24][CH2:25]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[N:5]1[S:6](=[O:18])(=[O:19])[C:7]([c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)=[C:8]([NH:32][c:29]2[cH:28][cH:27][c:26]([N:23]3[CH2:22][CH2:21][O:20][CH2:25][CH2:24]3)[n:31][cH:30]2)[C:9]1=[O:10]

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 1040596-(Morpholino)pyridin-3-amineHCID 672426272-tert-Butyl-4-chloro-5-phenylisothiazol-3(2H)-one 1,1-dioxide

Product 1

HCID 11503141HCID 11503141, compound

Sources & evidence

ORD record
ord-c9b18aacf53b4d859b8da64d99d580ec
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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